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DocumentationIdentifier: MM350477
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350477 |
| SMILES |
COC(C)C(=N)NCC=O
|
| InChIKey |
FFCATKXYDJSGMV-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM162512
Similarity: 0.7576
Similarity to MM162512
| Tanimoto metric | 0.7576 |
|---|---|
| Cosine metric | 0.8704 |
| Dice metric | 0.8621 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350197
Similarity: 0.7365
Similarity to MM350197
| Tanimoto metric | 0.7365 |
|---|---|
| Cosine metric | 0.8486 |
| Dice metric | 0.8482 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292844
Similarity: 0.719
Similarity to MM292844
| Tanimoto metric | 0.719 |
|---|---|
| Cosine metric | 0.8365 |
| Dice metric | 0.8365 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+338 more
